Harmonic Oscillator Staging Coordinates for Efficient Path Integral Simulations of Quantum Oscillators and Crystals-Reference-Cited by-同舟云学术

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Harmonic Oscillator Staging Coordinates for Efficient Path Integral Simulations of Quantum Oscillators and Crystals

Published:2024-08-07 Issue: Volume: Page:
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Moustafa Sabry G.¹^ORCID,Schultz Andrew J.²^ORCID

Affiliation:

1. Department of Engineering Science, Trinity University, San Antonio, Texas 78212, United States

2. Department of Chemical and Biological Engineering, University at Buffalo, The State University of New York, Buffalo, New York 14260-4200, United States

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.4c00522

Reference32 articles.

1. Nuclear quantum effects enter the mainstream

2. Path-integral simulation of solids

3. Statistical Mechanics: Theory and Molecular Simulation

4. Efficient molecular dynamics and hybrid Monte Carlo algorithms for path integrals

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